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CHEBI:224698 - Trichocadinin C

ChEBI IDCHEBI:224698
ChEBI NameTrichocadinin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O4
Net Charge0
Average Mass260.289
Monoisotopic Mass260.10486
SMILESC[C@H](CO)[C@H]1CCc2coc3cc(C(=O)O)cc1c23
InChIInChI=1S/C15H16O4/c1-8(6-16)11-3-2-9-7-19-13-5-10(15(17)18)4-12(11)14(9)13/h4-5,7-8,11,16H,2-3,6H2,1H3,(H,17,18)/t8-,11-/m1/s1
InChIKeyNJYGTKDUQVRJAI-LDYMZIIASA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - PubMed (31418264)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Trichocadinin C (CHEBI:224698) is a naphthoic acid (CHEBI:25483)
IUPAC Name 
(7R)-7-[(2S)-1-hydroxypropan-2-yl]-2-oxatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraene-10-carboxylic acid
Manual XrefsDatabases
128439855ChemSpider